2-[1-(5-bromanyl-2-ethoxy-phenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(5-bromanyl-2-ethoxy-phenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole Openeye Name: 2-[1-(5-bromo-2-ethoxy-phenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole CAS Name: 2-[1-(5-bromo-2-ethoxyphenyl)sulfonyl-2-pyrrolidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(5-bromo-2-ethoxyphenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole Traditional Name: 2-[1-(5-bromo-2-ethoxy-phenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole Formula: C19H20BrN3O3S MolecularWeight: 450.3494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCC2C3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCC2C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H20BrN3O3S/c1-2-26-17-10-9-13(20)12-18(17)27(24,25)23-11-5-8-16(23)19-21-14-6-3-4-7-15(14)22-19/h3-4,6-7,9-10,12,16H,2,5,8,11H2,1H3,(H,21,22)